9-[(3,5-difluorophenyl)methyl]-7-(furan-2-yl)carbazole-4-carboxamide

C24H16F2N2O2 — CID 174399760

IUPAC9-[(3,5-difluorophenyl)methyl]-7-(furan-2-yl)carbazole-4-carboxamide
SMILESNC(=O)c1cccc2c1c1ccc(-c3ccco3)cc1n2Cc1cc(F)cc(F)c1
InChIInChI=1S/C24H16F2N2O2/c25-16-9-14(10-17(26)12-16)13-28-20-4-1-3-19(24(27)29)23(20)18-7-6-15(11-21(18)28)22-5-2-8-30-22/h1-12H,13H2,(H2,27,29)
InChIKeySFYWLIUEOVWTFV-UHFFFAOYSA-N
MW402.40 g/mol
LogP5.48
Rot. Bonds4

About 9-[(3,5-difluorophenyl)methyl]-7-(furan-2-yl)carbazole-4-carboxamide

9-[(3,5-difluorophenyl)methyl]-7-(furan-2-yl)carbazole-4-carboxamide (PubChem CID 174399760) has the molecular formula C24H16F2N2O2 and a molecular weight of 402.40 g/mol. Its IUPAC name is 9-[(3,5-difluorophenyl)methyl]-7-(furan-2-yl)carbazole-4-carboxamide.

Molecular Properties

Compound Name9-[(3,5-difluorophenyl)methyl]-7-(furan-2-yl)carbazole-4-carboxamide
PubChem CID174399760
Molecular FormulaC24H16F2N2O2
Molecular Weight402.40 g/mol
Exact Mass402.12
IUPAC Name9-[(3,5-difluorophenyl)methyl]-7-(furan-2-yl)carbazole-4-carboxamide
SMILESNC(=O)c1cccc2c1c1ccc(-c3ccco3)cc1n2Cc1cc(F)cc(F)c1
InChIInChI=1S/C24H16F2N2O2/c25-16-9-14(10-17(26)12-16)13-28-20-4-1-3-19(24(27)29)23(20)18-7-6-15(11-21(18)28)22-5-2-8-30-22/h1-12H,13H2,(H2,27,29)
InChIKeySFYWLIUEOVWTFV-UHFFFAOYSA-N
XLogP5.48
TPSA61.16 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms30
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500402.40
LogP ≤ 55.48
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-[2-(4-Carboxypiperidin-1-Yl)-2-Oxoethyl]-3-Cyclohexyl-2-Furan-3-Yl-1h-Indole-6-Carboxylic Acid
CID 10435195
6-fluoro-3-[(3R,4R)-4-fluoropiperidin-3-yl]-2-(furan-3-yl)-1H-indole
CID 10542381
3-(1-Benzofuran-3-yl)-4-(5-fluoro-1-methylindol-3-yl)pyrrole-2,5-dione
CID 16741551
N-[2-(Furan-2-YL)ethyl]-1,2,3-trimethyl-1H-indole-5-carboxamide
CID 20940054
3-cyclohexyl-2-furan-3-yl-1-methyl-1H-indole-6-carboxylic acid
CID 514263
3-Cyclohexyl-1-dimethylcarbamoylmethyl-2-furan-3-yl-1H-indole-6-carboxylic acid
CID 6480931
3-(1-(2-(5-fluorobenzofuran-3-yl)ethyl)-1,2,3,6-tetrahydropyridin-4-yl)-1H-indole
CID 11164277
5-fluoro-3-(1-(2-(5-fluorobenzofuran-3-yl)ethyl)-1,2,3,6-tetrahydropyridin-4-yl)-1H-indole
CID 11188108
3-(1-(2-(benzofuran-3-yl)ethyl)-1,2,3,6-tetrahydropyridin-4-yl)-5-fluoro-1H-indole
CID 11245340
3-(1-(2-(benzofuran-3-yl)ethyl)-1,2,3,6-tetrahydropyridin-4-yl)-6-fluoro-1H-indole
CID 11428376
1-Allyl-3-cyclohexyl-2-(3-furyl)indole-6-carboxylic acid
CID 21105246
6-[(2,5-difluorophenyl)methyl]-8-(2-oxo-1H-pyridin-3-yl)furo[3,2-e]indole-7-carboxylic acid
CID 25173464

Frequently Asked Questions

What is the IUPAC name of 9-[(3,5-difluorophenyl)methyl]-7-(furan-2-yl)carbazole-4-carboxamide?
The IUPAC name of 9-[(3,5-difluorophenyl)methyl]-7-(furan-2-yl)carbazole-4-carboxamide (CID 174399760) is 9-[(3,5-difluorophenyl)methyl]-7-(furan-2-yl)carbazole-4-carboxamide.
What is the SMILES notation for 9-[(3,5-difluorophenyl)methyl]-7-(furan-2-yl)carbazole-4-carboxamide?
The canonical SMILES for 9-[(3,5-difluorophenyl)methyl]-7-(furan-2-yl)carbazole-4-carboxamide is NC(=O)c1cccc2c1c1ccc(-c3ccco3)cc1n2Cc1cc(F)cc(F)c1.
What is the InChIKey of 9-[(3,5-difluorophenyl)methyl]-7-(furan-2-yl)carbazole-4-carboxamide?
The InChIKey is SFYWLIUEOVWTFV-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H16F2N2O2/c25-16-9-14(10-17(26)12-16)13-28-20-4-1-3-19(24(27)29)23(20)18-7-6-15(11-21(18)28)22-5-2-8-30-22/h1-12H,13H2,(H2,27,29).
What are the key properties of 9-[(3,5-difluorophenyl)methyl]-7-(furan-2-yl)carbazole-4-carboxamide?
9-[(3,5-difluorophenyl)methyl]-7-(furan-2-yl)carbazole-4-carboxamide has a molecular weight of 402.40 g/mol, XLogP of 5.48, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 9-[(3,5-difluorophenyl)methyl]-7-(furan-2-yl)carbazole-4-carboxamide is sourced from PubChem (CID 174399760), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).